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755001

Sigma-Aldrich

(S)-2-(Trifluoromethyl)piperidine

97%

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Empirical Formula (Hill Notation):
C6H10F3N
CAS Number:
154727-51-2
Molecular Weight:
153.15
MDL number:
MFCD11226597
UNSPSC Code:
12352005
PubChem Substance ID:
329766472
NACRES:
NA.22

Assay

97%

form

liquid

optical activity

[α]22/D -14.4°, c = 0.5% in methanol

refractive index

n20/D 1.391

density

1.161 g/mL at 25 °C

SMILES string

FC(F)(F)[C@@H]1CCCCN1

InChI

1S/C6H10F3N/c7-6(8,9)5-3-1-2-4-10-5/h5,10H,1-4H2/t5-/m0/s1

InChI key

NAXDEFXCCITWEU-YFKPBYRVSA-N

Application

(S)-2-(Trifluoromethyl)piperidine can be used as a reactant for the synthesis of (1R,2R)-2-((S)-2-(trifluoromethyl)piperidin-1-yl)-1,2-dihydronaphthalen-1-ol by ring-opening reaction of oxabenzonorbornadiene in the presence of iridium catalyst.

Signal Word

Warning

Hazard Classifications

Acute Tox. 4 Oral - Aquatic Acute 1 - Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

WGK

WGK 3

Flash Point(F)

79.0 °F

Flash Point(C)

26.1 °C

Regulatory Information

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Water-Promoted Ir-Catalyzed Ring-Opening of Oxa (aza) benzonorbornadienes with Fluoroalkylamines
Yang X, et al.
The Journal of Organic Chemistry, 83(17), 10097-10106 (2018)

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